Information card for entry 7040985

Structure parameters

• Formula: C48 H4 B F36 O P
• Calculated formula: C48 H4 B F36 O P
• Title of publication: Electrophilic phenoxy-substituted phosphonium cations.
• Authors of publication: LaFortune, James H. W.; Johnstone, Timothy C.; Pérez, Manuel; Winkelhaus, Daniel; Podgorny, Vitali; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 45
• Pages of publication: 18156 - 18162
• a: 10.2204 ± 0.0007 Å
• b: 13.6806 ± 0.001 Å
• c: 18.2102 ± 0.0014 Å
• α: 109.296 ± 0.003°
• β: 106.289 ± 0.003°
• γ: 90.83 ± 0.004°
• Cell volume: 2290.5 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1267
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No